ethyl 2-[3-[4-[(4-methoxyphenyl)carbonylamino]phenyl]-1-adamantyl]ethanoate

Systemtic Name: ethyl 2-[3-[4-[(4-methoxyphenyl)carbonylamino]phenyl]-1-adamantyl]ethanoate Openeye Name: ethyl 2-[3-[4-[(4-methoxybenzoyl)amino]phenyl]-1-adamantyl]acetate CAS Name: 2-[3-[4-[[(4-methoxyphenyl)-oxomethyl]amino]phenyl]-1-adamantyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[3-[4-[(4-methoxybenzoyl)amino]phenyl]-1-adamantyl]acetate Traditional Name: 2-[3-[4-(p-anisoylamino)phenyl]-1-adamantyl]acetic acid ethyl ester Formula: C28H33NO4 MolecularWeight: 447.56592

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC12CC3CC(C1)CC(C3)(C2)C4=CC=C(C=C4)NC(=O)C5=CC=C(C=C5)OC

Isomeric SMILES

CCOC(=O)CC12CC3CC(C1)CC(C3)(C2)C4=CC=C(C=C4)NC(=O)C5=CC=C(C=C5)OC

InChI

InChI=1S/C28H33NO4/c1-3-33-25(30)17-27-13-19-12-20(14-27)16-28(15-19,18-27)22-6-8-23(9-7-22)29-26(31)21-4-10-24(32-2)11-5-21/h4-11,19-20H,3,12-18H2,1-2H3,(H,29,31)